1-(2-methyl-1,3-benzothiazol-6-yl)-3-[(1S,2S)-2-methylcyclohexyl]thiourea

Systemtic Name: 1-(2-methyl-1,3-benzothiazol-6-yl)-3-[(1S,2S)-2-methylcyclohexyl]thiourea Openeye Name: 1-(2-methyl-1,3-benzothiazol-6-yl)-3-[(1S,2S)-2-methylcyclohexyl]thiourea CAS Name: 1-(2-methyl-1,3-benzothiazol-6-yl)-3-[(1S,2S)-2-methylcyclohexyl]thiourea IUPAC Name: 1-(2-methyl-1,3-benzothiazol-6-yl)-3-[(1S,2S)-2-methylcyclohexyl]thiourea Traditional Name: 1-(2-methyl-1,3-benzothiazol-6-yl)-3-[(1S,2S)-2-methylcyclohexyl]thiourea Formula: C16H21N3S2 MolecularWeight: 319.48804

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NC(=S)NC2=CC3=C(C=C2)N=C(S3)C

Isomeric SMILES

C[C@H]1CCCC[C@@H]1NC(=S)NC2=CC3=C(C=C2)N=C(S3)C

InChI

InChI=1S/C16H21N3S2/c1-10-5-3-4-6-13(10)19-16(20)18-12-7-8-14-15(9-12)21-11(2)17-14/h7-10,13H,3-6H2,1-2H3,(H2,18,19,20)/t10-,13-/m0/s1